6-azanyl-1-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-1-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-[3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C27H25N7O4 MolecularWeight: 511.5319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)N3C4=C(C(C(=C(O4)N)C#N)C5=CC=CC=C5)C(=N3)C)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)N3C4=C(C(C(=C(O4)N)C#N)C5=CC=CC=C5)C(=N3)C)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C27H25N7O4/c1-15-23-24(18-8-6-5-7-9-18)21(13-28)26(29)38-27(23)33(31-15)20-10-11-22(37-4)19(12-20)14-32-17(3)25(34(35)36)16(2)30-32/h5-12,24H,14,29H2,1-4H3